6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide

C102H65Cl5F6N20O2 — CID 157319535

IUPAC6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide
SMILESCn1ccc(-c2cnc3ccc(-c4cccnc4-c4ccc(F)c(Cl)c4)cn23)n1.Fc1ccc(-c2ncccc2-c2ccc3ncc(-c4ccn[nH]4)n3c2)cc1Cl.NC(=O)c1ccnc2ccc(-c3cccnc3-c3cc(Cl)c(F)cc3F)cc12.NC(=O)c1ccnc2ccc(-c3cccnc3-c3cc(Cl)ccc3F)cc12.[H]/N=c1/cc(-c2cccnc2-c2cc(Cl)ccc2F)ccn1/C=N/[H]
InChIInChI=1S/C22H15ClFN5.C21H12ClF2N3O.C21H13ClFN5.C21H13ClFN3O.C17H12ClFN4/c1-28-10-8-19(27-28)20-12-26-21-7-5-15(13-29(20)21)16-3-2-9-25-22(16)14-4-6-18(24)17(23)11-14;22-16-9-15(17(23)10-18(16)24)20-12(2-1-6-27-20)11-3-4-19-14(8-11)13(21(25)28)5-7-26-19;22-16-10-13(3-5-17(16)23)21-15(2-1-8-24-21)14-4-6-20-25-11-19(28(20)12-14)18-7-9-26-27-18;22-13-4-5-18(23)17(11-13)20-14(2-1-8-26-20)12-3-6-19-16(10-12)15(21(24)27)7-9-25-19;18-12-3-4-15(19)14(9-12)17-13(2-1-6-22-17)11-5-7-23(10-20)16(21)8-11/h2-13H,1H3;1-10H,(H2,25,28);1-12H,(H,26,27);1-11H,(H2,24,27);1-10,20-21H/b;;;;20-10+,21-16-
InChIKeyBDZORSPKDBLSQB-QTYHALIWSA-N
MW1894.03 g/mol
LogP24.30
Rot. Bonds15

About 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide

6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide (PubChem CID 157319535) has the molecular formula C102H65Cl5F6N20O2 and a molecular weight of 1894.03 g/mol. Its IUPAC name is 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide.

Molecular Properties

Compound Name6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide
PubChem CID157319535
Molecular FormulaC102H65Cl5F6N20O2
Molecular Weight1894.03 g/mol
Exact Mass1890.39
IUPAC Name6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide
SMILESCn1ccc(-c2cnc3ccc(-c4cccnc4-c4ccc(F)c(Cl)c4)cn23)n1.Fc1ccc(-c2ncccc2-c2ccc3ncc(-c4ccn[nH]4)n3c2)cc1Cl.NC(=O)c1ccnc2ccc(-c3cccnc3-c3cc(Cl)c(F)cc3F)cc12.NC(=O)c1ccnc2ccc(-c3cccnc3-c3cc(Cl)ccc3F)cc12.[H]/N=c1/cc(-c2cccnc2-c2cc(Cl)ccc2F)ccn1/C=N/[H]
InChIInChI=1S/C22H15ClFN5.C21H12ClF2N3O.C21H13ClFN5.C21H13ClFN3O.C17H12ClFN4/c1-28-10-8-19(27-28)20-12-26-21-7-5-15(13-29(20)21)16-3-2-9-25-22(16)14-4-6-18(24)17(23)11-14;22-16-9-15(17(23)10-18(16)24)20-12(2-1-6-27-20)11-3-4-19-14(8-11)13(21(25)28)5-7-26-19;22-16-10-13(3-5-17(16)23)21-15(2-1-8-24-21)14-4-6-20-25-11-19(28(20)12-14)18-7-9-26-27-18;22-13-4-5-18(23)17(11-13)20-14(2-1-8-26-20)12-3-6-19-16(10-12)15(21(24)27)7-9-25-19;18-12-3-4-15(19)14(9-12)17-13(2-1-6-22-17)11-5-7-23(10-20)16(21)8-11/h2-13H,1H3;1-10H,(H2,25,28);1-12H,(H,26,27);1-11H,(H2,24,27);1-10,20-21H/b;;;;20-10+,21-16-
InChIKeyBDZORSPKDBLSQB-QTYHALIWSA-N
XLogP24.30
TPSA310.14 Ų
H-Bond Donors5
H-Bond Acceptors19
Rotatable Bonds15
Heavy Atoms135
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001894.03
LogP ≤ 524.30
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1019

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide?
The IUPAC name of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide (CID 157319535) is 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide.
What is the SMILES notation for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide?
The canonical SMILES for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide is Cn1ccc(-c2cnc3ccc(-c4cccnc4-c4ccc(F)c(Cl)c4)cn23)n1.Fc1ccc(-c2ncccc2-c2ccc3ncc(-c4ccn[nH]4)n3c2)cc1Cl.NC(=O)c1ccnc2ccc(-c3cccnc3-c3cc(Cl)c(F)cc3F)cc12.NC(=O)c1ccnc2ccc(-c3cccnc3-c3cc(Cl)ccc3F)cc12.[H]/N=c1/cc(-c2cccnc2-c2cc(Cl)ccc2F)ccn1/C=N/[H].
What is the InChIKey of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide?
The InChIKey is BDZORSPKDBLSQB-QTYHALIWSA-N. The full InChI is InChI=1S/C22H15ClFN5.C21H12ClF2N3O.C21H13ClFN5.C21H13ClFN3O.C17H12ClFN4/c1-28-10-8-19(27-28)20-12-26-21-7-5-15(13-29(20)21)16-3-2-9-25-22(16)14-4-6-18(24)17(23)11-14;22-16-9-15(17(23)10-18(16)24)20-12(2-1-6-27-20)11-3-4-19-14(8-11)13(21(25)28)5-7-26-19;22-16-10-13(3-5-17(16)23)21-15(2-1-8-24-21)14-4-6-20-25-11-19(28(20)12-14)18-7-9-26-27-18;22-13-4-5-18(23)17(11-13)20-14(2-1-8-26-20)12-3-6-19-16(10-12)15(21(24)27)7-9-25-19;18-12-3-4-15(19)14(9-12)17-13(2-1-6-22-17)11-5-7-23(10-20)16(21)8-11/h2-13H,1H3;1-10H,(H2,25,28);1-12H,(H,26,27);1-11H,(H2,24,27);1-10,20-21H/b;;;;20-10+,21-16-.
What are the key properties of 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide?
6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide has a molecular weight of 1894.03 g/mol, XLogP of 24.30, 15 rotatable bonds, 5 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(5-chloro-2,4-difluorophenyl)-3-pyridinyl]quinoline-4-carboxamide;4-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]-1-methanimidoylpyridin-2-imine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1-methylpyrazol-3-yl)imidazo[1,2-a]pyridine;6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-3-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine;6-[2-(5-chloro-2-fluorophenyl)-3-pyridinyl]quinoline-4-carboxamide is sourced from PubChem (CID 157319535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).